5-[2-[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxidanylidene-1H-pyrazol-4-yl]hydrazinyl]phthalazine-1,4-dione

Systemtic Name: 5-[2-[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxidanylidene-1H-pyrazol-4-yl]hydrazinyl]phthalazine-1,4-dione Openeye Name: 5-[2-[2-[4-(4-methoxyphenyl)thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]hydrazino]phthalazine-1,4-dione CAS Name: 5-[[2-[4-(4-methoxyphenyl)-2-thiazolyl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]hydrazo]phthalazine-1,4-dione IUPAC Name: 5-[2-[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-3-oxo-1H-pyrazol-4-yl]hydrazinyl]phthalazine-1,4-dione Traditional Name: 5-[N'-[5-keto-1-[4-(4-methoxyphenyl)thiazol-2-yl]-3-(4-nitrophenyl)-3-pyrazolin-4-yl]hydrazino]phthalazine-1,4-quinone Formula: C27H18N8O6S MolecularWeight: 582.54682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=C(C=C4)[N+](=O)[O-])NNC5=CC=CC6=C5C(=O)N=NC6=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=C(N3)C4=CC=C(C=C4)[N+](=O)[O-])NNC5=CC=CC6=C5C(=O)N=NC6=O

InChI

InChI=1S/C27H18N8O6S/c1-41-17-11-7-14(8-12-17)20-13-42-27(28-20)34-26(38)23(22(33-34)15-5-9-16(10-6-15)35(39)40)30-29-19-4-2-3-18-21(19)25(37)32-31-24(18)36/h2-13,29-30,33H,1H3